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Substance Name: Benzoic acid, 2-nitro-, compd. with cyclohexanamine (1:1)
RN: 34067-46-4
InChIKey: MSVSFNIUJZTDPA-UHFFFAOYSA-N

Molecular Formula

  • C7-H5-N-O4.C6-H13-N

Molecular Weight

  • 266.295
 
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Names and Synonyms

Synonyms

  • 2-Nitrobenzoic acid compd. with cyclohexanamine (1:1)
  • 2-Nitrobenzoic acid cyclohexylamine salt
  • Cyclohexylamine o-nitrobenzoate

Systematic Names

  • Benzoic acid, 2-nitro-, compd. with cyclohexanamine (1:1)
  • Benzoic acid, o-nitro-, compd. with cyclohexylamine (1:1) (8CI)

Registry Numbers

CAS Registry Number

  • 34067-46-4

System Generated Number

  • 0034067464

Molecular Formulas

Molecular Formula

  • C7-H5-N-O4.C6-H13-N

Molecular Formula Fragments

  • C6-H13-N
  • C7-H5-N-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C7H5NO4.C6H13N/c9-7(10)5-3-1-2-4-6(5)8(11)12;7-6-4-2-1-3-5-6/h1-4H,(H,9,10);6H,1-5,7H2

InChIKey

MSVSFNIUJZTDPA-UHFFFAOYSA-N

Smiles

C1(CCCCC1)N.C(c1c(cccc1)[N+](=O)[O-])(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 290mg/kg (290mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 29(11), Pg. 51, 1985.
rat LD50 oral 925mg/kg (925mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 29(11), Pg. 51, 1985.